Information card for entry 1512791

Structure parameters

• Formula: C7 H7 Cu N7 O
• Calculated formula: C7 H7 Cu N7 O
• Title of publication: Synthesis, crystal structure, antimicrobial activity and electrochemistry study of chromium(III) and copper(II) complexes based on semicarbazone Schiff base and azide ligands
• Authors of publication: B. Shaabani; A.A. Khandar; M. Dusek; M. Pojarova; F. Mahmoudi
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 394
• Pages of publication: 563 - 568
• a: 10.52999 ± 0.00014 Å
• b: 11.13677 ± 0.00015 Å
• c: 8.09356 ± 0.00012 Å
• α: 90°
• β: 99.9107 ± 0.0014°
• γ: 90°
• Cell volume: 934.97 ± 0.02 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0755
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 0.885
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No